SCHEMBL27142176

SCHEMBL27142176

CCCCCC(C)C(CCOC)OC

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.37
SMPD1 P17405 3/20 0.36
PTPN1 P18031 1/20 0.33
FDPS P14324 4/20 0.32
ZDHHC7 Q9NXF8 1/20 0.32
SPHK1 Q9NYA1 1/20 0.31
CA1 P00915 1/20 0.31
S1PR2 O95136 5/20 0.31
S1PR1 P21453 5/20 0.31
S1PR3 Q99500 5/20 0.31
S1PR4 O95977 4/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14339562 0.85 OPRM1 (0.41) OPRM1SMPD1PTPN1FDPSZDHHC7
SCHEMBL16056678 0.83 DNM1 (0.41) OPRM1SMPD1PTPN1ZDHHC7SPHK1
SCHEMBL5860767 0.83 SMPD1 (0.37) OPRM1SMPD1PTPN1FDPSZDHHC7
SCHEMBL6470973 0.80 OPRM1 (0.37) OPRM1SMPD1PTPN1ZDHHC7SPHK1
SCHEMBL1659278 0.80 OPRM1 (0.41) OPRM1SMPD1PTPN1ZDHHC7SPHK1
SCHEMBL8155646 0.79 PIK3CD (0.32)
SCHEMBL15664778 0.77 ZDHHC7 (0.37) OPRM1SMPD1PTPN1ZDHHC7SPHK1
SCHEMBL28303829 0.76 OPRM1 (0.37) OPRM1SMPD1FDPSZDHHC7SPHK1
SCHEMBL14525661 0.74 ACE2 (0.45) OPRM1SMPD1FDPSZDHHC7SPHK1
SCHEMBL1660642 0.73 ALDH1A1 (0.35) OPRM1PTPN1FDPSCA1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024008862-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2024-01-11 WO disclosed